3-(3-chlorophenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(3-chlorophenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(3-chlorophenyl)-2-(2-morpholino-2-oxo-ethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(3-chlorophenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(3-chlorophenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(3-chlorophenyl)-2-[(2-keto-2-morpholino-ethyl)thio]-5H-pyrimid[5,4-b]indol-4-one Formula: C22H19ClN4O3S MolecularWeight: 454.92926

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)NC5=CC=CC=C53

Isomeric SMILES

C1COCCN1C(=O)CSC2=NC3=C(C(=O)N2C4=CC(=CC=C4)Cl)NC5=CC=CC=C53

InChI

InChI=1S/C22H19ClN4O3S/c23-14-4-3-5-15(12-14)27-21(29)20-19(16-6-1-2-7-17(16)24-20)25-22(27)31-13-18(28)26-8-10-30-11-9-26/h1-7,12,24H,8-11,13H2